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PubMed code 26252963

Compile data set for download or QSAR
Found 15 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Delta-type opioid receptor


(MOUSE)
BDBM50114372
PNG
(CHEMBL3604279)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CCC1CN(CC=C)C2)c1cccc(OC)c1
Show InChI InChI=1/C28H37N3O2/c1-5-17-29-19-24-15-16-25(20-29)31(24)27(23-9-8-10-26(18-23)33-4)21-11-13-22(14-12-21)28(32)30(6-2)7-3/h5,8-14,18,24-25,27H,1,6-7,15-17,19-20H2,2-4H3
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0.340n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50114370
PNG
(CHEMBL3604281)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCC2CCC(C1)N2CC=C)c1cccc(OC)c1 |THB:13:14:22:18.19|
Show InChI InChI=1/C29H39N3O2/c1-5-18-32-25-15-16-26(32)21-31(19-17-25)28(24-9-8-10-27(20-24)34-4)22-11-13-23(14-12-22)29(33)30(6-2)7-3/h5,8-14,20,25-26,28H,1,6-7,15-19,21H2,2-4H3
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1.80n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50114373
PNG
(CHEMBL3604278)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CC1CN(CC=C)C2)c1cccc(OC)c1 |THB:13:14:23.19.18:16|
Show InChI InChI=1/C27H35N3O2/c1-5-15-28-18-23-17-24(19-28)30(23)26(22-9-8-10-25(16-22)32-4)20-11-13-21(14-12-20)27(31)29(6-2)7-3/h5,8-14,16,23-24,26H,1,6-7,15,17-19H2,2-4H3
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1.80n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50114371
PNG
(CHEMBL3604280)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CCCC1CN(CC=C)C2)c1cccc(OC)c1 |TLB:22:21:14:16.17.18|
Show InChI InChI=1/C29H39N3O2/c1-5-18-30-20-25-11-9-12-26(21-30)32(25)28(24-10-8-13-27(19-24)34-4)22-14-16-23(17-15-22)29(33)31(6-2)7-3/h5,8,10,13-17,19,25-26,28H,1,6-7,9,11-12,18,20-21H2,2-4H3
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1.90n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50114369
PNG
(CHEMBL3604282)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCC2CCCC(C1)N2CC=C)c1cccc(OC)c1 |TLB:24:23:18.19.20:22.15.16.14|
Show InChI InChI=1/C30H41N3O2/c1-5-19-33-26-11-9-12-27(33)22-32(20-18-26)29(25-10-8-13-28(21-25)35-4)23-14-16-24(17-15-23)30(34)31(6-2)7-3/h5,8,10,13-17,21,26-27,29H,1,6-7,9,11-12,18-20,22H2,2-4H3
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9.10n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50114370
PNG
(CHEMBL3604281)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCC2CCC(C1)N2CC=C)c1cccc(OC)c1 |THB:13:14:22:18.19|
Show InChI InChI=1/C29H39N3O2/c1-5-18-32-25-15-16-26(32)21-31(19-17-25)28(24-9-8-10-27(20-24)34-4)22-11-13-23(14-12-22)29(33)30(6-2)7-3/h5,8-14,20,25-26,28H,1,6-7,15-19,21H2,2-4H3
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183n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Mus musculus (Mouse))
BDBM50114372
PNG
(CHEMBL3604279)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CCC1CN(CC=C)C2)c1cccc(OC)c1
Show InChI InChI=1/C28H37N3O2/c1-5-17-29-19-24-15-16-25(20-29)31(24)27(23-9-8-10-26(18-23)33-4)21-11-13-22(14-12-21)28(32)30(6-2)7-3/h5,8-14,18,24-25,27H,1,6-7,15-17,19-20H2,2-4H3
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300n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50114369
PNG
(CHEMBL3604282)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCC2CCCC(C1)N2CC=C)c1cccc(OC)c1 |TLB:24:23:18.19.20:22.15.16.14|
Show InChI InChI=1/C30H41N3O2/c1-5-19-33-26-11-9-12-27(33)22-32(20-18-26)29(25-10-8-13-28(21-25)35-4)23-14-16-24(17-15-23)30(34)31(6-2)7-3/h5,8,10,13-17,21,26-27,29H,1,6-7,9,11-12,18-20,22H2,2-4H3
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950n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50114373
PNG
(CHEMBL3604278)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CC1CN(CC=C)C2)c1cccc(OC)c1 |THB:13:14:23.19.18:16|
Show InChI InChI=1/C27H35N3O2/c1-5-15-28-18-23-17-24(19-28)30(23)26(22-9-8-10-25(16-22)32-4)20-11-13-21(14-12-20)27(31)29(6-2)7-3/h5,8-14,16,23-24,26H,1,6-7,15,17-19H2,2-4H3
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1.15E+3n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Mus musculus (Mouse))
BDBM50114371
PNG
(CHEMBL3604280)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CCCC1CN(CC=C)C2)c1cccc(OC)c1 |TLB:22:21:14:16.17.18|
Show InChI InChI=1/C29H39N3O2/c1-5-18-30-20-25-11-9-12-26(21-30)32(25)28(24-10-8-13-27(19-24)34-4)22-14-16-23(17-15-22)29(33)31(6-2)7-3/h5,8,10,13-17,19,25-26,28H,1,6-7,9,11-12,18,20-21H2,2-4H3
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2.20E+3n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50114371
PNG
(CHEMBL3604280)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CCCC1CN(CC=C)C2)c1cccc(OC)c1 |TLB:22:21:14:16.17.18|
Show InChI InChI=1/C29H39N3O2/c1-5-18-30-20-25-11-9-12-26(21-30)32(25)28(24-10-8-13-27(19-24)34-4)22-14-16-23(17-15-22)29(33)31(6-2)7-3/h5,8,10,13-17,19,25-26,28H,1,6-7,9,11-12,18,20-21H2,2-4H3
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2.27E+3n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Mus musculus (Mouse))
BDBM50114370
PNG
(CHEMBL3604281)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCC2CCC(C1)N2CC=C)c1cccc(OC)c1 |THB:13:14:22:18.19|
Show InChI InChI=1/C29H39N3O2/c1-5-18-32-25-15-16-26(32)21-31(19-17-25)28(24-9-8-10-27(20-24)34-4)22-11-13-23(14-12-22)29(33)30(6-2)7-3/h5,8-14,20,25-26,28H,1,6-7,15-19,21H2,2-4H3
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2.45E+3n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50114372
PNG
(CHEMBL3604279)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CCC1CN(CC=C)C2)c1cccc(OC)c1
Show InChI InChI=1/C28H37N3O2/c1-5-17-29-19-24-15-16-25(20-29)31(24)27(23-9-8-10-26(18-23)33-4)21-11-13-22(14-12-21)28(32)30(6-2)7-3/h5,8-14,18,24-25,27H,1,6-7,15-17,19-20H2,2-4H3
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3.83E+3n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Mus musculus (Mouse))
BDBM50114373
PNG
(CHEMBL3604278)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C2CC1CN(CC=C)C2)c1cccc(OC)c1 |THB:13:14:23.19.18:16|
Show InChI InChI=1/C27H35N3O2/c1-5-15-28-18-23-17-24(19-28)30(23)26(22-9-8-10-25(16-22)32-4)20-11-13-21(14-12-20)27(31)29(6-2)7-3/h5,8-14,16,23-24,26H,1,6-7,15,17-19H2,2-4H3
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4.00E+3n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Mus musculus (Mouse))
BDBM50114369
PNG
(CHEMBL3604282)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCC2CCCC(C1)N2CC=C)c1cccc(OC)c1 |TLB:24:23:18.19.20:22.15.16.14|
Show InChI InChI=1/C30H41N3O2/c1-5-19-33-26-11-9-12-27(33)22-32(20-18-26)29(25-10-8-13-28(21-25)35-4)23-14-16-24(17-15-23)30(34)31(6-2)7-3/h5,8,10,13-17,21,26-27,29H,1,6-7,9,11-12,18-20,22H2,2-4H3
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4.25E+3n/an/an/an/an/an/an/an/a



Istituto di Farmacologia Traslazionale

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in mouse brain membranes by liquid scintillation counting method


Bioorg Med Chem 23: 5527-38 (2015)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%